SCHEMBL3729459

SCHEMBL3729459

Cc1ccc(C)n1C1=CC=CC(C2CCNCC2)N1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.36
PLAT P00750 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2039954 0.72 EPHX2 (0.32)
SCHEMBL3729457 0.72 PLAT (0.34) GPR119PLAT
SCHEMBL4236595 0.70 GPR119 (0.32) GPR119PLAT
SCHEMBL1274688 0.68 ALDH1A1 (0.41) MEN1KMT2A
SCHEMBL6833620 0.66 GPR119 (0.32) GPR119PLAT
SCHEMBL3073015 0.65 GPR119 (0.33) GPR119PLATMEN1KMT2A
SCHEMBL4242556 0.65 MEN1 (0.35) GPR119PLATMEN1KMT2A
SCHEMBL16963472 0.63 NR1H2 (0.59) GPR119MEN1KMT2A
SCHEMBL16963473 0.63 NR1H2 (0.59) GPR119MEN1KMT2A
SCHEMBL2811594 0.62 KDM4E (0.34) GPR119PLATMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825119-B2 Bone disorders such as osteoporosis, tumors and cardiovascular disorders; 4-(2-carboxy-2-Boc-aminoethylamino)-6-piperidinopyrimidines such as tert-butyl 2-benzyloxycarbonylamino-3-[2,5-dimethoxy-6-(4-[1,8]naphthyridin-2-yl-piperidin-1-yl)pyrimidin-4-ylamino]-propionate GALAPAGOS SAS (FR) 2010-11-02 US disclosed